2-Methylpropane-2-sulfinyl chloride

HCID 4686861

노트 반응

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기본 정보

CAS: 31562-43-3
표준 SMILES: CC(C)(C)S(=O)Cl
InChIKey: ZLJKQOWJEZSNBE-UHFFFAOYSA-N
분자식: C4H9ClOS
평균 분자량: 140.63 g/mol
단동위원소 질량: 140.00626359

이름 및 식별자

우선 이름: 2-Methylpropane-2-sulfinyl chloride
IUPAC: 2-methylpropane-2-sulfinyl chloride
영어명: tert-Butylsulfinyl chloride
분자식: C4H9ClOS
분자량: 140.63

이름 및 동의어

2-methylpropane-2-sulfinyl ChlorideRefChem:476185628-238-6tert-Butylsulfinyl chloride31562-43-32-METHYLPROPANE-2-SULFINIC CHLORIDEt-butylsulfinyl chloride2-methyl-2-propanesulfinyl chlorideMFCD049740741,1-dimethylethanesulfinyl chloride2-methylpropane-2-sulfinic acid chloridetert-Butylthionyl chloride

이름 더 보기

T-BUTYLSULFINYL CHLORIDE, 97%TERT-BUTYLSULFINYL CHLORIDE 97tert-Butylsulfinyl chloride 97%2-Propanesulfinyl chloride, 2-methyl-tert-Butylsulfinyl chloride ISO 9001：2015 REACH

SCHEMBL248927TERT-BUTYLSULFINYLCHLORIDEDTXSID40405575tert-Butylsulfinyl chloride, 97%2-methyl-propane-2-sulfinyl chlorideAKOS0089011162-METHYLPROPANE-2-SULFINICCHLORIDEAS-35634

데이터베이스 식별자

CAS: 31562-43-3
PubChem CID: 4686861
DTXSID: DTXSID40405575
EC Number: 628-238-6
Nikkaji: J918.770G

물성

구조 계산 물성

XLogP: 1.3
극성 표면적: 36.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 7
형식 전하: 0
복잡도: 84.2

물리화학적 성질

끓는 점: 53 · 53-54 °C/19 mmHg (lit.)
밀도: 1.135 g/mL · 1.135 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.4830(lit.)
인화점: 125 °F · 125 °F
저장 조건: 2 · Storage temp. 2-8°C
InChI: 1S/C4H9ClOS/c1-4(2,3)7(5)6/h1-3H3
InChIKey: ZLJKQOWJEZSNBE-UHFFFAOYSA-N
SMILES: CC(C)(C)S(Cl)=O

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

안전 데이터

wgk: 3
ridadr: UN 2920 8/PG 2
risk_code: 10-34
hazard_code: C
safety_code: 16-26-36/37/39-45
Hazard Classifications: Flam. Liq. 3Skin Corr. 1B
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

응용 분야 · 2건

용도tert-butylsulfinyl chloride can react with primary and secondary amines to form tert-butylsulfinamides, which on oxidation forms base stable tert-butylsulfonamide. It can also react with 1-thiosugars to form the corresponding carbohydrate thionolactones.

일반 설명tert-Butylsulfinyl chloride can be synthesized by using tert-butylmagnesium chloride as the starting material via a multi-step synthesis process.